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CHEBI:112587 - (8R,9R)-9-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one

ChEBI IDCHEBI:112587
ChEBI Name(8R,9R)-9-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one
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DownloadsMolfile
FormulaC24H35N5O5
Net Charge0
Average Mass473.574
Monoisotopic Mass473.26382
SMILESC[C@@H]1CN([C@@H](C)CO)C(=O)CCCn2nncc2CO[C@H]1CN(C)Cc1ccc2c(c1)OCO2
InChIInChI=1S/C24H35N5O5/c1-17-11-28(18(2)14-30)24(31)5-4-8-29-20(10-25-26-29)15-32-23(17)13-27(3)12-19-6-7-21-22(9-19)34-16-33-21/h6-7,9-10,17-18,23,30H,4-5,8,11-16H2,1-3H3/t17-,18+,23+/m1/s1
InChIKeyGOEWTOAFXZXQCM-STSQHVNTSA-N
ChEBI Ontology
Outgoing Relation(s)
(8R,9R)-9-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one (CHEBI:112587) is a azamacrocycle (CHEBI:52898)
(8R,9R)-9-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-5-one (CHEBI:112587) is a lactam (CHEBI:24995)
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